Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'E3 ubiquitin-protein ligase Mdm2' and Ligand = 'BDBM31228'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
E3 ubiquitin-protein ligase Mdm2 (Homo sapiens (Human))	BDBM31228 (CHEMBL182052 | isoindolinone scaffold, 14) Show SMILES CCCOC1(N(C(Cc2ccc(O)cc2)C(=O)OC)C(=O)c2ccccc12)c1ccccc1 Show InChI InChI=1S/C27H27NO5/c1-3-17-33-27(20-9-5-4-6-10-20)23-12-8-7-11-22(23)25(30)28(27)24(26(31)32-2)18-19-13-15-21(29)16-14-19/h4-16,24,29H,3,17-18H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.00E+4	n/a	n/a	n/a	n/a	7.4	4
University of Newcastle upon Tyne					Assay Description For initial testing, the compounds and controls were plated out in triplicate into clear 96-well plates (Nunc) in 10 ul aliquots to give final concen...				J Med Chem 49: 6209-21 (2006) Article DOI: 10.1021/jm0601194 BindingDB Entry DOI: 10.7270/Q2R49P3V
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